Vidarabine Monohydrate - ≥99% , CAS No.24356-66-9

CAS: 24356-66-9 Cat. No.: V119467 Summenformel: C₁₀H₁₃N₅O₄·H₂O Molekulargewicht: 267.25 EG-Nummer: 678-339-4 PubChem CID: 32326

GRADE & PURITY ≥99%

Synonyms

(2R,3S,4S,5R)-2-(6-amino-9H-purin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol hydrate | s5297 | VIDARABINE [JAN] | 9H-Purin-6-amine,9-b-D-arabinofuranosyl-,hydrate(1:1) | CHEBI:9978 | MFCD00150980 | DRG-0058 | 9-beta-D-Arabinofuranosyladenine monohydr

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Synonyme

(2R,3S,4S,5R)-2-(6-amino-9H-purin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol hydrate | s5297 | VIDARABINE [JAN] | 9H-Purin-6-amine,9-b-D-arabinofuranosyl-,hydrate(1:1) | CHEBI:9978 | MFCD00150980 | DRG-0058 | 9-beta-D-Arabinofuranosyladenine monohydr

Spezifikationen & Reinheit

≥99%

Storage

Store at 2-8°C,Argon charged

Verschickt in

Wet ice

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Reinheit

≥99%

Namen und Kennungen

• Pubchem Sid: 528776326
• Kanonisches Lächeln: C1=NC(=C2C(=N1)N(C=N2)C3C(C(C(O3)CO)O)O)N.O
• IUPAC Name: (2R,3S,4S,5R)-2-(6-aminopurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol;hydrate
• InChIKey: ZTHWFVSEMLMLKT-CAMOTBBTSA-N
• INCHI: 1S/C10H13N5O4.H2O/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(18)6(17)4(1-16)19-10;/h2-4,6-7,10,16-18H,1H2,(H2,11,12,13);1H2/t4-,6-,7+,10-;/m1./s1
• Isomere SMILES: C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@H]([C@@H]([C@H](O3)CO)O)O)N.O
• WGK Deutschland: 3
• RTECS: AU6200000
• Alternative CAS-Nummer: 5536-17-4
• PubChem CID: 32326
• Molekulargewicht: 267.25

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Nucleosides, nucleotides, and analogues
    • Klasse Purine nucleosides

• Kingdom: Organic compounds
• Superclass: Nucleosides, nucleotides, and analogues
• Klasse: Purine nucleosides
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Purine nucleosides
• Alternative Parents: Glycosylamines 6-aminopurines Pentoses Aminopyrimidines and derivatives N-substituted imidazoles Imidolactams Tetrahydrofurans Heteroaromatic compounds Secondary alcohols Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Organopnictogen compounds Primary alcohols Primary amines
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Purine nucleoside - Glycosyl compound - N-glycosyl compound - 6-aminopurine - Pentose monosaccharide - Purine - Imidazopyrimidine - Aminopyrimidine - N-substituted imidazole - Pyrimidine - Imidolactam - Monosaccharide - Azole - Tetrahydrofuran - Heteroaromatic compound - Imidazole - Secondary alcohol - Oxacycle - Azacycle - Organoheterocyclic compound - Primary amine - Amine - Alcohol - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Primary alcohol - Aromatic heteropolycyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as purine nucleosides. These are compounds comprising a purine base attached to a ribosyl or deoxyribosyl moiety.
• External Descriptors: adenine arabinoside

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Chemische und physikalische Eigenschaften

• Löslichkeit: Soluble in Dimethylformamide
• Empfindlichkeit: Air sensitive.
• Spezifische Drehung [α]: -3° (C=1,DMF)
• Schmelzpunkt (°C): 253 °C
• Molekulargewicht: 285.260 g/mol
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 2
• Exact Mass: 285.107 Da
• Monoisotopic Mass: 285.107 Da
• Topological Polar Surface Area: 141.000 Ų
• Heavy Atom Count: 20
• Formal Charge: 0
• Complexity: 335.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 4
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 2

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